Reaction Mechanisms for the Electrochemical Reduction of CO2 to CO and Formate on the Cu(100) Surface at 298 K from Quantum Mechanics Free Energy Calculations with Explicit Water

Cited by (453)

Items 101–200 of 453

1. Non-metal boron atoms on a CuB 12 monolayer as efficient catalytic sites for urea production
   Changyan Zhu, Chaoxia Wen, Miao Wang, Min Zhang, Yun Geng, Zhong‐Min Su · 2021 · Chemical Science
2. Edge‐Exposed Molybdenum Disulfide with N‐Doped Carbon Hybridization: A Hierarchical Hollow Electrocatalyst for Carbon Dioxide Reduction
   Haoyi Li, Xiaozhi Liu, Shuangming Chen, Deren Yang, Qi Zhang, Li Song, Hai Yan Xiao, Qinghua Zhang, Lin Gu, Xun Wang · 2019 · Advanced Energy Materials
3. 2020 Roadmap on gas-involved photo- and electro- catalysis
   Yulu Yang, Yang Tang, Haomin Jiang, Yongmei Chen, Pingyu Wan, Maohong Fan, Rongrong Zhang, Sana Ullah, Lun Pan, Ji‐Jun Zou et al. · 2019 · Chinese Chemical Letters
4. Photo/electrochemical urea synthesis via CO2 coupling with nitrogenous small molecules: Status and challenges for the development of mechanism and catalysts
   Jili Yuan, Lin Hu, Jun Huang, Yuqing Chen, Shanshan Qiao, Haibo Xie · 2023 · Applied Catalysis B: Environmental
5. Electrochemical CO 2 reduction to ethanol: from mechanistic understanding to catalyst design
   Tu N. Nguyen, Jiaxun Guo, Ashwini Sachindran, Fengwang Li, Ali Seifitokaldani, Cao‐Thang Dinh · 2021 · Journal of Materials Chemistry A
6. Metal oxides heterojunction derived Bi-In hybrid electrocatalyst for robust electroreduction of CO2 to formate
   Runze Ye, Jiaye Zhu, Yun Tong, Dongmei Feng, Pengzuo Chen · 2023 · Journal of Energy Chemistry
7. Disclosing CO2 Activation Mechanism by Hydroxyl-Induced Crystalline Structure Transformation in Electrocatalytic Process
   Qing Huang, Qiang Li, Jiang Liu, Yirong Wang, Rui Wang, Long‐Zhang Dong, Yu−Han Xia, Jin−Lan Wang, Ya‐Qian Lan · 2019 · Matter
8. Effect of mass transfer and kinetics in ordered Cu-mesostructures for electrochemical CO2 reduction
   Hakhyeon Song, Mintaek Im, Jun Tae Song, Jung-Ae Lim, Beom‐Sik Kim, Youngkook Kwon, Sangwoo Ryu, Jihun Oh · 2018 · Applied Catalysis B: Environmental
9. Recent advances in the utilization of copper sulfide compounds for electrochemical CO2 reduction
   Yingkang Chen, Kejun Chen, Junwei Fu, Akira Yamaguchi, Hongmei Li, Hao Pan, Junhua Hu, Masahiro Miyauchi, Min Liu · 2019 · Nano Materials Science
10. Surface Ligand Promotion of Carbon Dioxide Reduction through Stabilizing Chemisorbed Reactive Intermediates
    Zhijiang Wang, Lina Wu, Kun Sun, Ting Chen, Zhaohua Jiang, Tao Cheng, William A. Goddard · 2018 · The Journal of Physical Chemistry Letters
11. Design strategies and mechanism studies of CO2 electroreduction catalysts based on coordination chemistry
    Ruizhe Zhang, Boyuan Wu, Qiang Li, Lele Lu, Wei Shi, Peng Cheng · 2020 · Coordination Chemistry Reviews
12. Critical Role of Explicit Inclusion of Solvent and Electrode Potential in the Electrochemical Description of Nitrogen Reduction
    Sheng−Jie Qian, Hao Cao, Jiewei Chen, Jun-Chi Chen, Yang‐Gang Wang, Jun Li · 2022 · ACS Catalysis
13. Selective CO 2 Reduction over γ-Graphyne Supported Single-Atom Catalysts: Crucial Role of Strain Regulation
    Tianyang Liu, Tianze Xu, Tianchun Li, Yu Jing · 2024 · Journal of the American Chemical Society
14. Recent Progress in the Theoretical Investigation of Electrocatalytic Reduction of CO 2
    Ziqi Tian, Chad W. Priest, Liang Chen · 2018 · Advanced Theory and Simulations
15. Inverted Region in Electrochemical Reduction of CO 2 Induced by Potential-Dependent Pauli Repulsion
    Leyu Liu, Hai Yan Xiao · 2023 · Journal of the American Chemical Society
16. Dual-Facet Mechanism in Copper Nanocubes for Electrochemical CO2 Reduction into Ethylene
    Giulia Mangione, Jianfeng Huang, Raffaella Buonsanti, Clémence Corminbœuf · 2019 · The Journal of Physical Chemistry Letters
17. Relationship between the Surface Reconstruction of Nickel Phosphides and Their Activity toward the Hydrogen Evolution Reaction
    Sayan Banerjee, Arvin Kakekhani, Robert B. Wexler, Andrew M. Rappe · 2023 · ACS Catalysis
18. Single transition metal atom catalysts on Ti2CN2 for efficient CO2 reduction reaction
    Feifei Li, Haoqiang Ai, Changmin Shi, Kin Ho Lo, Hui Pan · 2021 · International Journal of Hydrogen Energy
19. Accurate descriptions of molecule-surface interactions in electrocatalytic CO2 reduction on the copper surfaces
    Zheng Chen, Zhangyun Liu, Xin Xu · 2023 · Nature Communications
20. Highly Selective Electrocatalytic Reduction of CO2 into Methane on Cu–Bi Nanoalloys
    Zhijiang Wang, Qi Yuan, Jingjing Shan, Zhaohua Jiang, Ping Xu, Yongfeng Hu, Jigang Zhou, Lina Wu, Zhuang‐Zhuang Niu, Jianmin Sun et al. · 2020 · The Journal of Physical Chemistry Letters
21. Electron-withdrawing functional ligand promotes CO2 reduction catalysis in single atom catalyst
    Xinyi Ren, Song Liu, Huicong Li, Jie Ding, Linghui Liu, Zhichong Kuang, Ling Li, Hongbin Yang, Fuquan Bai, Yanqiang Huang et al. · 2020 · Science China Chemistry
22. Atomic design of carbon-based dual-metal site catalysts for energy applications
    Huishan Shang, Di Liu · 2023 · Nano Research
23. Electrochemical CO2 reduction toward multicarbon alcohols - The microscopic world of catalysts & process conditions
    Theresa Jaster, Alina Gawel, Daniel Siegmund, Johannes Holzmann, Heiko Lohmann, Elias Klemm, Ulf‐Peter Apfel · 2022 · iScience
24. An interactive study of catalyst and mechanism for electrochemical CO2 reduction to formate on Pd surfaces
    Tian‐Wen Jiang, Xianxian Qin, Ke Ye, Wei-Yi Zhang, Hong Li, Wenhui Liu, Shengjuan Huo, Xia‐Guang Zhang, Kun Peng Jiang, Wen‐Bin Cai · 2023 · Applied Catalysis B: Environmental
25. Perspective on Theoretical Models for CO2 Electrochemical Reduction
    Xu Zhang, Zhen Ping Zhou · 2022 · The Journal of Physical Chemistry C
26. Advancing the Electrochemistry of Gas‐Involved Reactions through Theoretical Calculations and Simulations from Microscopic to Macroscopic
    Yanzheng He, Sisi Liu, Mengfan Wang, Haoqing Ji, Lifang Zhang, Qiyang Cheng, Tao Qian, Chenglin Yan · 2022 · Advanced Functional Materials
27. Recent progress in electrochemical reduction of CO2 by oxide-derived copper catalysts
    Shanwen Wang, Tianyi Kou, Sarah E. Baker, Eric B. Duoss, Yat Li · 2020 · Materials Today Nano
28. Combining First-Principles Kinetics and Experimental Data to Establish Guidelines for Product Selectivity in Electrochemical CO 2 Reduction
    Georg Kastlunger, Hendrik H. Heenen, Nitish Govindarajan · 2023 · ACS Catalysis
29. The identification of optimal active boron sites for N2 reduction
    Hui Yin, L. Gan, Ping Wang · 2020 · Journal of Materials Chemistry A
30. Modeling and Upscaling Analysis of Gas Diffusion Electrode-Based Electrochemical Carbon Dioxide Reduction Systems
    Ziming Yang, Da Li, Lei Xing, Hang Xiang, Jin Xuan, Shaoan Cheng, Eileen Hao Yu, Aidong Yang · 2020 · ACS Sustainable Chemistry & Engineering
31. Binary copper-bismuth catalysts for the electrochemical reduction of CO2: Study on surface properties and catalytic activity
    Cátia Azenha, Cécilia Mateos-Pedrero, Manuel Álvarez-Guerra, Ángel Irabien, Adélio Miguel Magalhães Mendes · 2022 · Chemical Engineering Journal
32. Electrochemically deposited Sn catalysts with dense tips on a gas diffusion electrode for electrochemical CO 2 reduction
    Jinkyu Lim, Phil Woong Kang, Sun Seo Jeon, Hyunjoo Lee · 2020 · Journal of Materials Chemistry A
33. Cu-based bimetallic catalysts for CO2 reduction reaction
    Xiqing Wang, Qin Chen, Yajiao Zhou, Hongmei Li, Junwei Fu, Min Liu · 2022 · Advanced Sensor and Energy Materials
34. Reaction mechanisms for reduction of CO2 to CO on monolayer MoS2
    Yunlong Xie, Xiang Li, Yu Wang, Biwen Li, Lun Yang, Nian Zhao, Meifeng Liu, Xiuzhang Wang, Ying Yu, Jun‐Ming Liu · 2019 · Applied Surface Science
35. Mechanistic understanding and design of non-noble metal-based single-atom catalysts supported on two-dimensional materials for CO 2 electroreduction
    Ya Huang, Faisal Rehman, Mohsen Tamtaji, Xuning Li, Yanqiang Huang, Tao Zhang, Zhengtang Luo · 2021 · Journal of Materials Chemistry A
36. Can Metal–Nitrogen–Carbon Single-Atom Catalysts Boost the Electroreduction of Carbon Monoxide?
    Tianyang Liu, Yu Wang, Yafei Li · 2023 · JACS Au
37. Copper‐Bismuth Bimetallic Microspheres for Selective Electrocatalytic Reduction of CO2 to Formate
    Jia Horng Lin, Hui Yang, Jun Deng, Junmei Chen, Yuan Zhou, Pan Ding, Leigang Li, Na Han, Yanguang Li · 2019 · Chinese Journal of Chemistry
38. Electrocatalytic Reduction of CO2 to CH4 and CO in Aqueous Solution Using Pyridine-Porphyrins Immobilized onto Carbon Nanotubes
    Maryam Abdinejad, Caitlin Dao, Billy Deng, Filip Dinic, Oleksandr Voznyy, Xiaoan Zhang, Heinz‐Bernhard Kraatz · 2020 · ACS Sustainable Chemistry & Engineering
39. Iron Dissolution from Goethite (α-FeOOH) Surfaces in Water by Ab Initio Enhanced Free-Energy Simulations
    Konstantin Klyukin, Kevin M. Rosso, Vitaly Alexandrov · 2018 · The Journal of Physical Chemistry C
40. Electroreduction Reaction Mechanism of Carbon Dioxide to C2 Products via Cu/Au Bimetallic Catalysis: A Theoretical Prediction
    Xia‐Guang Zhang, Shishi Feng, Chao Zhan, De‐Yin Wu, Yi Zhao, Zhong‐Qun Tian · 2020 · The Journal of Physical Chemistry Letters
41. Electric Field Mediated Selectivity Switching of Electrochemical CO2 Reduction from Formate to CO on Carbon Supported Sn
    Mi‐Young Lee, Stefan Ringe, Hyungjun Kim, Seoktae Kang, Youngkook Kwon · 2020 · ACS Energy Letters
42. Tuning Structures and Microenvironments of Cu-Based Catalysts for Sustainable CO 2 and CO Electroreduction
    Ximeng Lv, Zhengzheng Liu, Chao Yang, Yali Ji, Gengfeng Zheng · 2023 · Accounts of Materials Research
43. Selective Electrocatalytic Mechanism of CO2 Reduction Reaction to CO on Silver Electrodes: A Unique Reaction Intermediate
    Xia‐Guang Zhang, Xi Jin, De‐Yin Wu, Zhong‐Qun Tian · 2018 · The Journal of Physical Chemistry C
44. Electrochemical organic reactions: A tutorial review
    Joyeeta Lodh, Shounik Paul, He Sun, Luyang Song, Wolfgang Schöfberger, Soumyajit Roy · 2023 · Frontiers in Chemistry
45. High-Throughput Computational Screening of Bioinspired Dual-Atom Alloys for CO2 Activation
    Drew Behrendt, Sayan Banerjee, Cole Clark, Andrew M. Rappe · 2023 · Journal of the American Chemical Society
46. Insight into the Formation and Transfer Process of the First Intermediate of CO2 Reduction over Ag‐Decorated Dendritic Cu
    Yang Yang, Saira Ajmal, Yiqing Feng, Kejian Li, Xiuzhen Zheng, Liwu Zhang · 2019 · Chemistry - A European Journal
47. Advances and challenges in modeling solvated reaction mechanisms for renewable fuels and chemicals
    Yasemin Basdogan, Alex M. Maldonado, John A. Keith · 2019 · Wiley Interdisciplinary Reviews Computational Molecular Science
48. Heterogenized Pyridine-Substituted Cobalt(II) Phthalocyanine Yields Reduction of CO2 by Tuning the Electron Affinity of the Co Center
    Alberto De Riccardis, Michelle Lee, Roman V. Kazantsev, Alejandro J. Garza, Guosong Zeng, David M. Larson, Ezra Lee Clark, Peter Lobaccaro, Paul Burroughs, Ermelinda Bloise et al. · 2020 · ACS Applied Materials & Interfaces
49. Multi-Center Cooperativity Enables Facile C–C Coupling in Electrochemical CO2 Reduction on a Ni2P Catalyst
    Shisheng Zheng, Xianhui Liang, Junjie Pan, Kang Hu, Shunning Li, Feng Ming Pan · 2023 · ACS Catalysis
50. Fine AgPd Nanoalloys Achieving Size and Ensemble Synergy for High‐Efficiency CO2 to CO Electroreduction
    Qing Zeng, Shaonan Tian, Hui Liu, Lin Xu, Penglei Cui, Dong Chen, Jing Wang, Jun Yang · 2023 · Advanced Functional Materials
51. Cu-based materials for electrocatalytic CO2 to alcohols: Reaction mechanism, catalyst categories, and regulation strategies
    Yaru Lei, Yaxin Niu, Xiaolong Tang, Xiangtao Yu, Xiubing Huang, Xiaoqiu Lin, Honghong Yi, Shunzheng Zhao, Jiaying Jiang, Jiyue Zhang et al. · 2024 · Journal of Energy Chemistry
52. Recent Progress toward Ab Initio Modeling of Electrocatalysis
    Jiabo Le, Xiaohui Yang, Yong‐Bin Zhuang, Mei Lin Jia, Jun Jie Cheng · 2021 · The Journal of Physical Chemistry Letters
53. A perspective on the electrocatalytic conversion of carbon dioxide to methanol with metallomacrocyclic catalysts
    Xinyan Liu, Bo‐Quan Li, Bing Ni, Lei Wang, Hong‐Jie Peng · 2021 · Journal of Energy Chemistry
54. Ionic liquid-assisted synthesis of Cu7Te4 ultrathin nanosheets with enhanced electrocatalytic activity for water oxidation
    Qing Qin, Guofeng Zhang, Zhenzhen Chai, Jing Zhang, Yingxue Cui, Tianyu Li, Wenjun Zheng · 2017 · Nano Energy
55. Efficient Reduction of CO 2 to CO Using Cobalt–Cobalt Oxide Core–Shell Catalysts
    Guoheng Yin, Xiaotao Yuan, Xian‐Long Du, Wei Zhao, Qingyuan Bi, Fuqiang Huang · 2017 · Chemistry - A European Journal
56. Efficient electrochemical transformation of CO 2 to C 2 /C 3 chemicals on benzimidazole-functionalized copper surfaces
    Shenghong Zhong, Xiulin Yang, Zhen Zhu Cao, Xinglong Dong, Sergey M. Kozlov, Laura Falivene, Jing‐Kai Huang, Xiaofeng Zhou, Mohamed Nejib Hedhili, Zhiping Lai et al. · 2018 · Chemical Communications
57. The coupling of experiments with density functional theory in the studies of the electrochemical hydrogen evolution reaction
    Mingpeng Chen, Tyler J. Smart, Shanwen Wang, Tianyi Kou, Dun Lin, Yuan Ping, Yat Li · 2020 · Journal of Materials Chemistry A
58. Tandem Electrocatalytic CO 2 Reduction with Efficient Intermediate Conversion over Pyramid-Textured Cu–Ag Catalysts
    Ya Liu, Haoran Qiu, Jinghan Li, Liejin Guo, Joel W. Ager · 2021 · ACS Applied Materials & Interfaces
59. Neural network potentials for accelerated metadynamics of oxygen reduction kinetics at Au–water interfaces
    Xin Li Yang, Arghya Bhowmik, Tejs Vegge, Heine Anton Hansen · 2023 · Chemical Science
60. Realistic Modeling of the Electrocatalytic Process at Complex Solid‐Liquid Interface
    Hongyan Zhao, Xinmao Lv, Yang‐Gang Wang · 2023 · Advanced Science
61. Electroreduction of Carbon Dioxide in Metallic Nanopores through a Pincer Mechanism
    Yi Feng, Chuanqi Cheng, Chengqin Zou, X. R. Zheng, Jing Mao, Hui Liu, Zhe Li, Cunku Dong, Xi‐Wen Du · 2020 · Angewandte Chemie International Edition
62. Linear Correlation between Water Adsorption Energies and Volta Potential Differences for Metal/water Interfaces
    Xiang-Ying Li, Ao Chen, Xiaohui Yang, Jiaxin Zhu, Jiabo Le, Jun Jie Cheng · 2021 · The Journal of Physical Chemistry Letters
63. Artificial Intelligence and QM/MM with a Polarizable Reactive Force Field for Next-Generation Electrocatalysts
    Saber Naserifar, Yalu Chen, Soonho Kwon, Hai Yan Xiao, William A. Goddard · 2020 · Matter
64. Heterogeneous Electrocatalysts for CO2 Reduction
    Chao Yang, Yuhang Wang, Linping Qian, Abdullah M. Al‐Enizi, Lijuan Zhang, Gengfeng Zheng · 2021 · ACS Applied Energy Materials
65. Predicted Structures of the Active Sites Responsible for the Improved Reduction of Carbon Dioxide by Gold Nanoparticles
    Cheng, Tao, Huang, Yufeng, Xiao, Hai, Goddard, William A. · 2017 · The Journal of Physical Chemistry Letters
66. Thermodynamic and Kinetic Competition between C–H and O–H Bond Formation Pathways during Electrochemical Reduction of CO on Copper Electrodes
    Shi−Qin Xiang, Junlin Shi, Shuting Gao, Wei Zhang, Liu‐Bin Zhao · 2021 · ACS Catalysis
67. Ionic Liquid‐Induced Product Switching in CO 2 Electroreduction on Copper Reaction Interface
    Huizhu Cai, Hengpan Yang, Jianpeng Feng, Kangjie Zhou, Changsha Liu, Qi Lin Hu, Chuanxin He · 2024 · Advanced Functional Materials
68. Electrocatalytic conversion of CO2 to hydrocarbon and alcohol products: Realities and prospects of Cu-based materials
    Kayode Adesina Adegoke, Rhoda Oyeladun Adegoke, Asiata Omotayo Ibrahim, Samson Ademola Adegoke, Olugbenga Solomon Bello · 2020 · Sustainable materials and technologies
69. Catalytic role of assembled Ce Lewis acid sites over ceria for electrocatalytic conversion of dinitrogen to ammonia
    Jiamin Qi, Shulan Zhou, Ke Xie, Sen Lin · 2021 · Journal of Energy Chemistry
70. Theoretical understanding of the electrochemical reaction barrier: a kinetic study of CO 2 reduction reaction on copper electrodes
    Shuting Gao, Shi−Qin Xiang, Junlin Shi, Wei Zhang, Liu‐Bin Zhao · 2020 · Physical Chemistry Chemical Physics
71. Molecular Dynamics Simulations for Electrocatalytic CO 2 Reduction: Bridging Macroscopic Experimental Observations and Microscopic Explanatory Mechanisms
    Yanzheng He, Mengfan Wang, Haoqing Ji, Qiyang Cheng, Sisi Liu, Yunfei Huan, Tao Qian, Chenglin Yan · 2024 · Advanced Functional Materials
72. How Strain Alters CO2 Electroreduction on Model Cu(001) Surfaces
    Taewoo Kim, Rishi E. Kumar, Jeffrey A. Brock, Eric E. Fullerton, David P. Fenning · 2021 · ACS Catalysis
73. Electrifying HCOOH synthesis from CO 2 building blocks over Cu–Bi nanorod arrays
    Guiru Zhang, Bing Tan, Dong Hyeon Mok, Huiya Liu, Baoxin Ni, Gui Zhao, Ke Ye, Shengjuan Huo, Xiaohe Miao, Zheng Liang et al. · 2024 · Proceedings of the National Academy of Sciences
74. First-principles–based reaction kinetics from reactive molecular dynamics simulations: Application to hydrogen peroxide decomposition
    Daniil V. Ilyin, William A. Goddard, Julius J. Oppenheim, Tao Cheng · 2018 · Proceedings of the National Academy of Sciences
75. Metal chalcogenide-associated catalysts enabling CO 2 electroreduction to produce low-carbon fuels for energy storage and emission reduction: catalyst structure, morphology, performance, and mechanism
    Xiaolin Shao, Xurui Zhang, Yuyu Liu, Jinli Qiao, Xiao‐Dong Zhou, Nengneng Xu, Jamie L. Malcombe, Yi Jin, Jiujun Zhang · 2020 · Journal of Materials Chemistry A
76. Spin Uncoupling in Chemisorbed OCCO and CO2: Two High-Energy Intermediates in Catalytic CO2 Reduction
    Svante Hedström, Egon Campos dos Santos, Chang Liu, Karen Chan, Frank Abild‐Pedersen, Lars G. M. Pettersson · 2018 · The Journal of Physical Chemistry C
77. Wet-chemical synthesis and applications of amorphous metal-containing nanomaterials
    Jinzhe Liang, Yiyao Ge, Zhen He, Qinbai Yun, Guigao Liu, Shiyao Lu, Li Zhai, Biao Huang, Hua Zhang · 2021 · Nano Research
78. Lateral Adsorbate Interactions Inhibit HCOO − while Promoting CO Selectivity for CO 2 Electrocatalysis on Silver
    Divya Bohra, Isis Ledezma‐Yanez, Guanna Li, Wiebren de Jong, Evgeny A. Pidko, Wilson A. Smith · 2018 · Angewandte Chemie
79. Metal sulfide-based nanomaterials for electrochemical CO 2 reduction
    Anirban Mukherjee, Maryam Abdinejad, Susanta Sinha Mahapatra, Bidhan Chandra Ruidas · 2023 · Journal of Materials Chemistry A
80. Photoanode driven photoelectrocatalytic system for CO2 reduction to formic acid by using CoOx cathode
    Donglai Pan, Xingyu Ye, Yingnan Cao, Sai Zhu, Xiaofeng Chen, Ming Chen, Dieqing Zhang, Guisheng Li · 2020 · Applied Surface Science
81. Selective CO2-to-HCOOH Electroreduction on Graphdiyne-Supported Bimetallic Single-Cluster Catalysts
    Bin Chen, Yafei Jiang, Hai Yan Xiao, Jun Li · 2024 · ACS Catalysis
82. Effect of the coordination environment of Cu in Cu 2 O on the electroreduction of CO 2 to ethylene
    Yahui Wu, Chunjun Chen, Xupeng Yan, Shoujie Liu, Mengen Chu, Haihong Wu, Jun Ma, Buxing Han · 2020 · Green Chemistry
83. Role of High-Index Facet Cu(711) Surface in Controlling the C2 Selectivity for CO 2 Reduction Reaction—A DFT Study
    Chun‐Chih Chang, Min-Shao Ku · 2021 · The Journal of Physical Chemistry C
84. Tunable Product Selectivity in Electrochemical CO 2 Reduction on Well-Mixed Ni–Cu Alloys
    Hakhyeon Song, Ying Chuan Tan, Beomil Kim, Stefan Ringe, Jihun Oh · 2021 · ACS Applied Materials & Interfaces
85. Tuning Gold Nanoparticles with Chelating Ligands for Highly Efficient Electrocatalytic CO2 Reduction
    Zhi Min Cao, Samson B. Zacate, Xiaodong Sun, Jinjia Liu, Elizabeth M. Hale, William Carson, Sam B. Tyndall, Jun Xu, Xingwu Liu, Xingchen Liu et al. · 2018 · Angewandte Chemie
86. Electric Double Layer Structure in Electrocatalytic Carbon Dioxide Reduction
    Tao Luo, Kang Liu, Junwei Fu, Shanyong Chen, Hongmei Li, Hao Pan, Min Liu · 2022 · Advanced Energy and Sustainability Research
87. The role of nitrogen sources and hydrogen adsorption on the dynamic stability of Fe–N–C catalysts in oxygen reduction reaction
    Huang Zhou, Fuhua Li, Yongduo Liu, Siguo Chen, Zidong Wei, Qing Hua Tang · 2023 · Chemical Science
88. Metal‐Organic Frameworks‐Based Copper Catalysts for CO 2 Electroreduction Toward Multicarbon Products
    Qin kai Chen, Xuheng Li, Ting Wang, Zhen Cheng Xu, Kai‐Jie Chen, Fuping Pan · 2025 · Exploration
89. Mechanistic Insights into CO2 Electroreduction on Ni2P: Understanding Its Selectivity toward Multicarbon Products
    Sayan Banerjee, Arvin Kakekhani, Robert B. Wexler, Andrew M. Rappe · 2021 · ACS Catalysis
90. Proton‐Coupled Electron Transfer on Cu ₂ O/Ti ₃ C ₂ T _x MXene for Propane (C ₃ H ₈ ) Synthesis from Electrochemical CO ₂ Reduction
    Kim, Jun Young, Hong, Won Tae, Phu, Thi Kim Cuong, Cho, Seong Chan, Kim, Byeongkyu, Baeck, Unbeom, Oh, Hyung‐Suk, Koh, Jai Hyun, Yu, Xu, Choi, Chang Hyuck et al. · 2024 · Advanced Science
91. Synthesis, Structural Characterization, and CO2Reactivity of a Constitutionally Analogous Series of Tricopper Mono-, Di-, and Trihydrides
    Andrew W. Beamer, Joshua A. Buss · 2023 · Journal of the American Chemical Society
92. Electrochemical reduction of CO2 and CO using interface-engineered Au/Ti electrodes for long-chain hydrocarbon production
    Young Jun Kim, Ju Young Maeng, Seon Young Hwang, Choong Kyun Rhee, Youngku Sohn · 2023 · Applied Catalysis B: Environmental
93. Controlling the Selectivity of Electrocatalytic NO Reduction through pH and Potential Regulation on Single-Atom Catalysts
    Sheng−Jie Qian, Hao Cao, Yang‐Gang Wang, Jun Li · 2024 · Journal of the American Chemical Society
94. Multiscale Modeling of CO 2 Electrochemical Reduction on Copper Electrocatalysts: A Review of Advancements, Challenges, and Future Directions
    Reza Gholizadeh, Matic Pavlin, Matej Huš, Blaž Likozar · 2024 · ChemSusChem
95. Ti3C2 MXene nanosheets integrated cobalt-doped nickel hydroxide heterostructured composite: An efficient electrocatalyst for overall water-splitting
    Amaranadha Reddy Manchuri, Kamakshaiah Charyulu Devarayapalli, Bolam Kim, Youngsu Lim, Dae Sung Lee · 2024 · Green Energy & Environment
96. Ab Initio Metadynamics Study of the VO2+/VO2+ Redox Reaction Mechanism at the Graphite Edge/Water Interface
    Zhen Wei Jiang, Konstantin Klyukin, Vitaly Alexandrov · 2018 · ACS Applied Materials & Interfaces
97. Ionomers Modify the Selectivity of Cu‐Catalyzed Electrochemical CO 2 Reduction
    Miyeon Chang, Wenhao Ren, Weiyan Ni, Seunghwa Lee, Xile Hu · 2022 · ChemSusChem
98. Recent advances in single-atom catalysts for acidic electrochemical oxygen reduction to hydrogen peroxide
    Qian Jiang Zhang, Lufan Zheng, Jinting Wu, Jinting Wu, Jian Ping Gao, Yong‐Chao Zhang, Xiaodong Zhu · 2023 · Nano Energy
99. Role of oxygen in copper-based catalysts for carbon dioxide electrochemical reduction
    Qiancheng Zhou, Wei Zhang, Minqiang Qiu, Ying Yu · 2021 · Materials Today Physics
100. Insights into the Structure-Sensitive Catalytic Performance of Palladium–Copper Alloys in Electrochemical Urea Synthesis
     Xiaorong Zhu, Yafei Li · 2023 · ACS Catalysis